SCHEMBL19004809

SCHEMBL19004809

CCOCCOC(=O)c1ccc(C(=O)OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
CYP3A4 P08684 2/20 0.54
ABCB11 O95342 1/20 0.54
ADRA2B P18089 1/20 0.54
OPRD1 P41143 1/20 0.54
SCN5A Q14524 1/20 0.54
MAPT P10636 3/20 0.53
ESR1 P03372 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
TSHR P16473 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CHRM1 P11229 1/20 0.51
SLC6A2 P23975 1/20 0.51
KDR P35968 1/20 0.51
TP53 P04637 1/20 0.51
THRB P10828 1/20 0.51
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 2/20 0.50
CA7 P43166 2/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17797870 0.93 ALDH1A1 (0.58) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
SCHEMBL23522273 0.91 MAPT (0.58) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
SCHEMBL17797886 0.91 ALDH1A1 (0.56) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
SCHEMBL15068275 0.89 MAPT (0.64) SMN1; SMN2MAPTESR1TDP1TSHR
SCHEMBL14012592 0.88 CYP3A4 (0.59) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
Acetic Acid SCHEMBL27352564 0.87 LMNA (0.55) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
SCHEMBL10379919 0.86 MAPT (0.61) SMN1; SMN2CYP3A4MAPTESR1TSHR
SCHEMBL15702249 0.86 TSHR (0.52) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
SCHEMBL17824365 0.86 MAPT (0.54) SMN1; SMN2CYP3A4ABCB11ADRA2BOPRD1
SCHEMBL30014083 0.86 ESR1 (0.55) SMN1; SMN2CYP3A4MAPTESR1TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10450411-B2 Copolyesterimides comprising bis(2-hydroxyalkyl)-2,2′-(1,4-phenylene)bis(1,3-dioxoisoindoline-5-carboxylate) and articles made therefrom DUPONT TEIJIN FILMS U.S. LIMITED PARTNERSHIP (US) 2019-10-22 US disclosed
US-20170174831-A1 COPOLYESTERIMIDES COMPRISING BIS(2-HYDROXYALKYL)-2,2'-(1,4-PHENYLENE)BIS(1,3-DIOXOISOINDOLINE-5-CARBOXYLATE) AND ARTICLES MADE THEREFROM DUPONT TEIJIN FILMS U.S. LIMITED PARTNERSHIP (US) 2017-06-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10450411-B2 Copolyesterimides comprising bis(2-hydroxyalkyl)-2,2′-(1,4-phenylene)bis(1,3-dioxoisoindoline-5-carboxylate) and articles made therefrom NOTUM, WEE1, WEE2 SMN1; SMN2 3360/4885CYP3A4 814/4885ABCB11 3204/4885
US-20170174831-A1 COPOLYESTERIMIDES COMPRISING BIS(2-HYDROXYALKYL)-2,2'-(1,4-PHENYLENE)BIS(1,3-DIOXOISOINDOLINE-5-CARBOXYLATE) AND ARTICLES MADE THEREFROM PUF60, PDS5A, DDT SMN1; SMN2 2623/4885CYP3A4 413/4885ABCB11 3294/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.